SCHEMBL9534309

SCHEMBL9534309

CC(C)CCc1c(C(=O)O)n(CC(C)C)c(=O)n1Cc1ccc(-c2ccccc2C(=O)O)cc1

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BRS3 P32247 1/20 0.48
AGTR1 P30556 1/20 0.48
AGTR2 P50052 1/20 0.48

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9532678 0.94 BRS3 (0.50) BRS3AGTR1AGTR2
SCHEMBL9535160 0.92 PPARG (0.53)
SCHEMBL9555320 0.92 AGTR1 (0.50) AGTR1AGTR2
SCHEMBL9038808 0.92 AGTR1 (0.50) BRS3AGTR1AGTR2
SCHEMBL9555471 0.90 AGTR1 (0.53) AGTR1AGTR2
SCHEMBL9554771 0.90 BRS3 (0.49) BRS3AGTR1AGTR2
SCHEMBL9555494 0.90 AGTR1 (0.58) AGTR1AGTR2
SCHEMBL9554172 0.90 BRS3 (0.48) BRS3AGTR1AGTR2
SCHEMBL9554040 0.90 BRS3 (0.48) BRS3AGTR1AGTR2
SCHEMBL9554291 0.89 BRS3 (0.48) BRS3AGTR1AGTR2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5238952-A Treating glaucoma disorders G. D. SEARLE & CO. (US) 1993-08-24 US disclosed
EP-0555331-A1 N-SUBSTITUTED IMIDAZOL-2-ONE COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS. SEARLE & CO (US) 1993-08-18 EP disclosed
WO-1992007834-A1 N-SUBSTITUTED IMIDAZOL-2-ONE COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS G.D. SEARLE & CO. (US) 1992-05-14 WO disclosed
US-5087634-A N-substituted imidazol-2-one compounds for treatment of circulatory disorders G. D. SEARLE & CO. (US) 1992-02-11 US disclosed